Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9928634 | 1.00 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| SCHEMBL3010478 | 0.80 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| SCHEMBL525172 | 0.80 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| SCHEMBL11555633 | 0.80 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| SCHEMBL11555635 | 0.80 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| SCHEMBL29892208 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL17817782 | 0.77 | CES2 (0.35) | ALDH1A1TSHR | |
| SCHEMBL18916963 | 0.77 | CES2 (0.35) | ALDH1A1TSHR | |
| SCHEMBL21518311 | 0.76 | ALDH1A1 (0.40) | ALDH1A1TSHRHSD17B10LMNAFAAH | |
| SCHEMBL21518313 | 0.76 | ALDH1A1 (0.40) | ALDH1A1TSHRHSD17B10LMNAFAAH |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8202542-B1 | Abuse resistant opioid drug-ion exchange resin complexes having hybrid coatings | TRIS PHARMA (US) | 2012-06-19 | — | — | US | disclosed |